(2S)-2-acetamido-N-[[3-(aminomethyl)phenyl]methyl]-2-phenyl-ethanamide; vanadium; hydrate

Systemtic Name: (2S)-2-acetamido-N-[[3-(aminomethyl)phenyl]methyl]-2-phenyl-ethanamide; vanadium; hydrate Openeye Name: (2S)-2-acetamido-N-[[3-(aminomethyl)phenyl]methyl]-2-phenyl-acetamide; vanadium; hydrate CAS Name: (2S)-2-acetamido-N-[[3-(aminomethyl)phenyl]methyl]-2-phenylacetamide; vanadium; hydrate IUPAC Name: (2S)-2-acetamido-N-[[3-(aminomethyl)phenyl]methyl]-2-phenylacetamide; vanadium; hydrate Traditional Name: (2S)-2-acetamido-N-[3-(aminomethyl)benzyl]-2-phenyl-acetamide; vanadium; hydrate Formula: C18H23N3O3V MolecularWeight: 380.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CC=C1)C(=O)NCC2=CC=CC(=C2)CN.O.[V]

Isomeric SMILES

CC(=O)N[C@@H](C1=CC=CC=C1)C(=O)NCC2=CC=CC(=C2)CN.O.[V]

InChI

InChI=1S/C18H21N3O2.H2O.V/c1-13(22)21-17(16-8-3-2-4-9-16)18(23)20-12-15-7-5-6-14(10-15)11-19;;/h2-10,17H,11-12,19H2,1H3,(H,20,23)(H,21,22);1H2;/t17-;;/m0../s1