methyl 3-[3-azanyl-5-naphthalen-2-yl-4-(3-phenylpropoxy)phenyl]propanoate

Systemtic Name: methyl 3-[3-azanyl-5-naphthalen-2-yl-4-(3-phenylpropoxy)phenyl]propanoate Openeye Name: methyl 3-[3-amino-5-(2-naphthyl)-4-(3-phenylpropoxy)phenyl]propanoate CAS Name: 3-[3-amino-5-(2-naphthalenyl)-4-(3-phenylpropoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-amino-5-naphthalen-2-yl-4-(3-phenylpropoxy)phenyl]propanoate Traditional Name: 3-[3-amino-5-(2-naphthyl)-4-(3-phenylpropoxy)phenyl]propionic acid methyl ester Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=C(C(=C1)C2=CC3=CC=CC=C3C=C2)OCCCC4=CC=CC=C4)N

Isomeric SMILES

COC(=O)CCC1=CC(=C(C(=C1)C2=CC3=CC=CC=C3C=C2)OCCCC4=CC=CC=C4)N

InChI

InChI=1S/C29H29NO3/c1-32-28(31)16-13-22-18-26(25-15-14-23-11-5-6-12-24(23)20-25)29(27(30)19-22)33-17-7-10-21-8-3-2-4-9-21/h2-6,8-9,11-12,14-15,18-20H,7,10,13,16-17,30H2,1H3