butyl (Z)-3-azanyl-2-[4-(diphenylmethyl)piperazin-1-yl]but-2-enoate

Systemtic Name: butyl (Z)-3-azanyl-2-[4-(diphenylmethyl)piperazin-1-yl]but-2-enoate Openeye Name: butyl (Z)-3-amino-2-(4-benzhydrylpiperazin-1-yl)but-2-enoate CAS Name: (Z)-3-amino-2-[4-(diphenylmethyl)-1-piperazinyl]-2-butenoic acid butyl ester IUPAC Name: butyl (Z)-3-amino-2-(4-benzhydrylpiperazin-1-yl)but-2-enoate Traditional Name: (Z)-3-amino-2-(4-benzhydrylpiperazino)but-2-enoic acid butyl ester Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=C(C)N)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)/C(=C(\C)/N)/N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-3-4-19-30-25(29)23(20(2)26)27-15-17-28(18-16-27)24(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14,24H,3-4,15-19,26H2,1-2H3/b23-20-