2-diethylaminoethyl 3-butoxy-4-[[2-(methylamino)-3-naphthalen-2-yl-propanoyl]amino]benzoate

Systemtic Name: 2-diethylaminoethyl 3-butoxy-4-[[2-(methylamino)-3-naphthalen-2-yl-propanoyl]amino]benzoate Openeye Name: 2-diethylaminoethyl 3-butoxy-4-[[2-(methylamino)-3-(2-naphthyl)propanoyl]amino]benzoate CAS Name: 3-butoxy-4-[[2-(methylamino)-3-(2-naphthalenyl)-1-oxopropyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-butoxy-4-[[2-(methylamino)-3-naphthalen-2-ylpropanoyl]amino]benzoate Traditional Name: 3-butoxy-4-[[2-(methylamino)-3-(2-naphthyl)propanoyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C31H41N3O4 MolecularWeight: 519.67494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)NC(=O)C(CC2=CC3=CC=CC=C3C=C2)NC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)NC(=O)C(CC2=CC3=CC=CC=C3C=C2)NC

InChI

InChI=1S/C31H41N3O4/c1-5-8-18-37-29-22-26(31(36)38-19-17-34(6-2)7-3)15-16-27(29)33-30(35)28(32-4)21-23-13-14-24-11-9-10-12-25(24)20-23/h9-16,20,22,28,32H,5-8,17-19,21H2,1-4H3,(H,33,35)