methyl (Z,4S)-4-[bis(phenylmethyl)amino]-2-formamido-5-phenylmethoxy-pent-2-enoate

Systemtic Name: methyl (Z,4S)-4-[bis(phenylmethyl)amino]-2-formamido-5-phenylmethoxy-pent-2-enoate Openeye Name: methyl (Z,4S)-5-benzyloxy-4-(dibenzylamino)-2-formamido-pent-2-enoate CAS Name: (Z,4S)-4-[bis(phenylmethyl)amino]-2-formamido-5-phenylmethoxy-2-pentenoic acid methyl ester IUPAC Name: methyl (Z,4S)-4-(dibenzylamino)-2-formamido-5-phenylmethoxypent-2-enoate Traditional Name: (Z,4S)-5-benzoxy-4-(dibenzylamino)-2-formamido-pent-2-enoic acid methyl ester Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC(COCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)NC=O

Isomeric SMILES

COC(=O)/C(=C/[C@@H](COCC1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)/NC=O

InChI

InChI=1S/C28H30N2O4/c1-33-28(32)27(29-22-31)17-26(21-34-20-25-15-9-4-10-16-25)30(18-23-11-5-2-6-12-23)19-24-13-7-3-8-14-24/h2-17,22,26H,18-21H2,1H3,(H,29,31)/b27-17-/t26-/m0/s1