diethyl 2-[(E)-3-[4-(hexadecylamino)phenyl]prop-2-enoyl]oxybutanedioate

Systemtic Name: diethyl 2-[(E)-3-[4-(hexadecylamino)phenyl]prop-2-enoyl]oxybutanedioate Openeye Name: diethyl 2-[(E)-3-[4-(hexadecylamino)phenyl]prop-2-enoyl]oxybutanedioate CAS Name: 2-[(E)-3-[4-(hexadecylamino)phenyl]-1-oxoprop-2-enoxy]butanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-3-[4-(hexadecylamino)phenyl]prop-2-enoyl]oxybutanedioate Traditional Name: 2-[(E)-3-[4-(cetylamino)phenyl]acryloyl]oxysuccinic acid diethyl ester Formula: C33H53NO6 MolecularWeight: 559.77702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC(=O)OC(CC(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C(=O)OC(CC(=O)OCC)C(=O)OCC

InChI

InChI=1S/C33H53NO6/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-26-34-29-23-20-28(21-24-29)22-25-31(35)40-30(33(37)39-6-3)27-32(36)38-5-2/h20-25,30,34H,4-19,26-27H2,1-3H3/b25-22+