methyl (Z)-2-[(methoxycarbonylamino)-naphthalen-2-yl-methyl]-3-[(phenylmethyl)amino]but-2-enoate

Systemtic Name: methyl (Z)-2-[(methoxycarbonylamino)-naphthalen-2-yl-methyl]-3-[(phenylmethyl)amino]but-2-enoate Openeye Name: methyl (Z)-3-(benzylamino)-2-[(methoxycarbonylamino)-(2-naphthyl)methyl]but-2-enoate CAS Name: (Z)-2-[(methoxycarbonylamino)-(2-naphthalenyl)methyl]-3-[(phenylmethyl)amino]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-(benzylamino)-2-[(methoxycarbonylamino)-naphthalen-2-ylmethyl]but-2-enoate Traditional Name: (Z)-3-(benzylamino)-2-[(carbomethoxyamino)-(2-naphthyl)methyl]but-2-enoic acid methyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(C1=CC2=CC=CC=C2C=C1)NC(=O)OC)C(=O)OC)NCC3=CC=CC=C3

Isomeric SMILES

C/C(=C(\C(C1=CC2=CC=CC=C2C=C1)NC(=O)OC)/C(=O)OC)/NCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O4/c1-17(26-16-18-9-5-4-6-10-18)22(24(28)30-2)23(27-25(29)31-3)21-14-13-19-11-7-8-12-20(19)15-21/h4-15,23,26H,16H2,1-3H3,(H,27,29)/b22-17-