benzoic acid; ethyl 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)ethanoate

Systemtic Name: benzoic acid; ethyl 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)ethanoate Openeye Name: benzoic acid; ethyl 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)acetate CAS Name: benzoic acid; 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)acetic acid ethyl ester IUPAC Name: benzoic acid; ethyl 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)acetate Traditional Name: benzoic acid; 2-(7-formamido-4,4-dimethyl-3H-naphthalen-1-yl)acetic acid ethyl ester Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CCC(C2=C1C=C(C=C2)NC=O)(C)C.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCOC(=O)CC1=CCC(C2=C1C=C(C=C2)NC=O)(C)C.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C17H21NO3.C7H6O2/c1-4-21-16(20)9-12-7-8-17(2,3)15-6-5-13(18-11-19)10-14(12)15;8-7(9)6-4-2-1-3-5-6/h5-7,10-11H,4,8-9H2,1-3H3,(H,18,19);1-5H,(H,8,9)