ethyl (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-phenyl-propanoyl]amino]-5-phenyl-pent-2-enoate

Systemtic Name: ethyl (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-phenyl-propanoyl]amino]-5-phenyl-pent-2-enoate Openeye Name: ethyl (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-phenyl-propanoyl]amino]-5-phenyl-pent-2-enoate CAS Name: (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxo-3-phenylpropyl]amino]-5-phenyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-3-phenylpropanoyl]amino]-5-phenylpent-2-enoate Traditional Name: (E,4S)-4-[[(2S)-2-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]-3-phenyl-propanoyl]amino]-5-phenyl-pent-2-enoic acid ethyl ester Formula: C33H36N2O6 MolecularWeight: 556.64874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)/C=C/[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)/C=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C33H36N2O6/c1-4-41-32(37)20-17-27(21-24-11-7-5-8-12-24)34-33(38)28(22-25-13-9-6-10-14-25)35-31(36)19-16-26-15-18-29(39-2)30(23-26)40-3/h5-20,23,27-28H,4,21-22H2,1-3H3,(H,34,38)(H,35,36)/b19-16+,20-17+/t27-,28+/m1/s1