(Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]piperidin-2-yl]but-2-enedioic acid

Systemtic Name: (Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]piperidin-2-yl]but-2-enedioic acid Openeye Name: (Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]-2-piperidyl]but-2-enedioic acid CAS Name: (Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]-2-piperidinyl]-2-butenedioic acid IUPAC Name: (Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]piperidin-2-yl]but-2-enedioic acid Traditional Name: (Z)-2-[4-[4-(3-methylbut-2-enylamino)phenoxy]-2-piperidyl]but-2-enedioic acid Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCNC1=CC=C(C=C1)OC2CCNC(C2)C(=CC(=O)O)C(=O)O)C

Isomeric SMILES

CC(=CCNC1=CC=C(C=C1)OC2CCNC(C2)/C(=C/C(=O)O)/C(=O)O)C

InChI

InChI=1S/C20H26N2O5/c1-13(2)7-9-21-14-3-5-15(6-4-14)27-16-8-10-22-18(11-16)17(20(25)26)12-19(23)24/h3-7,12,16,18,21-22H,8-11H2,1-2H3,(H,23,24)(H,25,26)/b17-12-