(2R)-2-[[(E)-2-[(4-butoxyphenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[[(E)-2-[(4-butoxyphenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: (2R)-2-[[(E)-2-[(4-butoxybenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(E)-2-[[(4-butoxyphenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[[(E)-2-[(4-butoxybenzoyl)amino]-3-phenylprop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[(E)-2-[(4-butoxybenzoyl)amino]-3-phenyl-acryloyl]amino]-3-phenyl-propionate Formula: C29H29N2O5- MolecularWeight: 485.55096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CC=C2)/C(=O)N[C@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C29H30N2O5/c1-2-3-18-36-24-16-14-23(15-17-24)27(32)30-25(19-21-10-6-4-7-11-21)28(33)31-26(29(34)35)20-22-12-8-5-9-13-22/h4-17,19,26H,2-3,18,20H2,1H3,(H,30,32)(H,31,33)(H,34,35)/p-1/b25-19+/t26-/m1/s1