methyl 4-[(2-azanyl-3-naphthalen-2-yl-propanoyl)amino]-3-butoxy-benzoate

Systemtic Name: methyl 4-[(2-azanyl-3-naphthalen-2-yl-propanoyl)amino]-3-butoxy-benzoate Openeye Name: methyl 4-[[2-amino-3-(2-naphthyl)propanoyl]amino]-3-butoxy-benzoate CAS Name: 4-[[2-amino-3-(2-naphthalenyl)-1-oxopropyl]amino]-3-butoxybenzoic acid methyl ester IUPAC Name: methyl 4-[(2-amino-3-naphthalen-2-ylpropanoyl)amino]-3-butoxybenzoate Traditional Name: 4-[[2-amino-3-(2-naphthyl)propanoyl]amino]-3-butoxy-benzoic acid methyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O4/c1-3-4-13-31-23-16-20(25(29)30-2)11-12-22(23)27-24(28)21(26)15-17-9-10-18-7-5-6-8-19(18)14-17/h5-12,14,16,21H,3-4,13,15,26H2,1-2H3,(H,27,28)