propyl 4-[3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]benzoate

Systemtic Name: propyl 4-[3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoylamino]benzoate Openeye Name: propyl 4-[3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(4-benzoxy-3-bromo-5-methoxy-phenyl)acryloyl]amino]benzoic acid propyl ester Formula: C27H26BrNO5 MolecularWeight: 524.40304

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H26BrNO5/c1-3-15-33-27(31)21-10-12-22(13-11-21)29-25(30)14-9-20-16-23(28)26(24(17-20)32-2)34-18-19-7-5-4-6-8-19/h4-14,16-17H,3,15,18H2,1-2H3,(H,29,30)