methanal; O4-[2-(2-oxidanylidene-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl] O1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] (Z)-but-2-enedioate

Systemtic Name: methanal; O4-[2-(2-oxidanylidene-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl] O1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] (Z)-but-2-enedioate Openeye Name: formaldehyde; O4-[2-(2-oxo-2-pyrrolidin-3-yl-ethyl)piperazin-1-yl] O1-[(E)-3-(3,4,5-trimethoxyphenyl)allyl] (Z)-but-2-enedioate CAS Name: (Z)-2-butenedioic acid O4-[2-[2-oxo-2-(3-pyrrolidinyl)ethyl]-1-piperazinyl] ester O1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] ester; formaldehyde IUPAC Name: formaldehyde; 4-O-[2-(2-oxo-2-pyrrolidin-3-ylethyl)piperazin-1-yl] 1-O-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enyl] (Z)-but-2-enedioate Traditional Name: (Z)-but-2-enedioic acid O4-[2-(2-keto-2-pyrrolidin-3-yl-ethyl)piperazino] ester O1-[(E)-3-(3,4,5-trimethoxyphenyl)allyl] ester; formaldehyde Formula: C27H37N3O9 MolecularWeight: 547.59738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CCOC(=O)C=CC(=O)ON2CCNCC2CC(=O)C3CCNC3.C=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/COC(=O)/C=C\C(=O)ON2CCNCC2CC(=O)C3CCNC3.C=O

InChI

InChI=1S/C26H35N3O8.CH2O/c1-33-22-13-18(14-23(34-2)26(22)35-3)5-4-12-36-24(31)6-7-25(32)37-29-11-10-28-17-20(29)15-21(30)19-8-9-27-16-19;1-2/h4-7,13-14,19-20,27-28H,8-12,15-17H2,1-3H3;1H2/b5-4+,7-6-;