2-azanyl-N-[2-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]-3-(4-phenylmethoxyphenyl)propanamide hydrochloride

Systemtic Name: 2-azanyl-N-[2-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]-3-(4-phenylmethoxyphenyl)propanamide hydrochloride Openeye Name: 2-amino-3-(4-benzyloxyphenyl)-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]propanamide hydrochloride CAS Name: 2-amino-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-(4-phenylmethoxyphenyl)propanamide hydrochloride IUPAC Name: 2-amino-N-[2-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-3-(4-phenylmethoxyphenyl)propanamide hydrochloride Traditional Name: 2-amino-3-(4-benzoxyphenyl)-N-[2-(4-keto-3,1-benzoxazin-2-yl)phenyl]propionamide hydrochloride Formula: C30H26ClN3O4 MolecularWeight: 527.99814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5C(=O)O4)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5C(=O)O4)N.Cl

InChI

InChI=1S/C30H25N3O4.ClH/c31-25(18-20-14-16-22(17-15-20)36-19-21-8-2-1-3-9-21)28(34)32-26-12-6-4-10-23(26)29-33-27-13-7-5-11-24(27)30(35)37-29;/h1-17,25H,18-19,31H2,(H,32,34);1H