ethyl 4-[[(Z)-1-(1-adamantyl)-3-(4-ethoxycarbonylphenyl)imino-prop-1-enyl]amino]benzoate

Systemtic Name: ethyl 4-[[(Z)-1-(1-adamantyl)-3-(4-ethoxycarbonylphenyl)imino-prop-1-enyl]amino]benzoate Openeye Name: ethyl 4-[[(Z)-1-(1-adamantyl)-3-(4-ethoxycarbonylphenyl)imino-prop-1-enyl]amino]benzoate CAS Name: 4-[[(Z)-1-(1-adamantyl)-3-(4-ethoxycarbonylphenyl)iminoprop-1-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(Z)-1-(1-adamantyl)-3-(4-ethoxycarbonylphenyl)iminoprop-1-enyl]amino]benzoate Traditional Name: 4-[[(Z)-1-(1-adamantyl)-3-(4-carbethoxyphenyl)imino-prop-1-enyl]amino]benzoic acid ethyl ester Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=CC=NC2=CC=C(C=C2)C(=O)OCC)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/C(=C\C=NC2=CC=C(C=C2)C(=O)OCC)/C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C31H36N2O4/c1-3-36-29(34)24-5-9-26(10-6-24)32-14-13-28(31-18-21-15-22(19-31)17-23(16-21)20-31)33-27-11-7-25(8-12-27)30(35)37-4-2/h5-14,21-23,33H,3-4,15-20H2,1-2H3/b28-13-,32-14?