[6-cyano-4-(3-dodecoxy-5-oxidanylidene-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [6-cyano-4-(3-dodecoxy-5-oxidanylidene-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-4-(3-dodecoxy-5-oxo-2H-pyrrol-1-yl)-2,2-dimethyl-chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-4-(3-dodecoxy-5-oxo-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-4-(3-dodecoxy-5-oxo-2H-pyrrol-1-yl)-2,2-dimethyl-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-(2-keto-4-lauryloxy-3-pyrrolin-1-yl)-2,2-dimethyl-chroman-3-yl] ester Formula: C30H42N2O5 MolecularWeight: 510.66488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)OC(=O)C

InChI

InChI=1S/C30H42N2O5/c1-5-6-7-8-9-10-11-12-13-14-17-35-24-19-27(34)32(21-24)28-25-18-23(20-31)15-16-26(25)37-30(3,4)29(28)36-22(2)33/h15-16,18-19,28-29H,5-14,17,21H2,1-4H3