[(Z)-[1-azanyl-2-(3,4-dimethoxyphenyl)ethylidene]amino] adamantane-1-carboxylate

Systemtic Name: [(Z)-[1-azanyl-2-(3,4-dimethoxyphenyl)ethylidene]amino] adamantane-1-carboxylate Openeye Name: [(Z)-[1-amino-2-(3,4-dimethoxyphenyl)ethylidene]amino] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [(Z)-[1-amino-2-(3,4-dimethoxyphenyl)ethylidene]amino] ester IUPAC Name: [(Z)-[1-amino-2-(3,4-dimethoxyphenyl)ethylidene]amino] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [(Z)-[1-amino-2-(3,4-dimethoxyphenyl)ethylidene]amino] ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=NOC(=O)C23CC4CC(C2)CC(C4)C3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C/C(=N/OC(=O)C23CC4CC(C2)CC(C4)C3)/N)OC

InChI

InChI=1S/C21H28N2O4/c1-25-17-4-3-13(8-18(17)26-2)9-19(22)23-27-20(24)21-10-14-5-15(11-21)7-16(6-14)12-21/h3-4,8,14-16H,5-7,9-12H2,1-2H3,(H2,22,23)