prop-2-enyl N-[[3-(aminomethyl)phenyl]methyl]carbamate; vanadium; hydrate

Systemtic Name: prop-2-enyl N-[[3-(aminomethyl)phenyl]methyl]carbamate; vanadium; hydrate Openeye Name: allyl N-[[3-(aminomethyl)phenyl]methyl]carbamate; vanadium; hydrate CAS Name: N-[[3-(aminomethyl)phenyl]methyl]carbamic acid prop-2-enyl ester; vanadium; hydrate IUPAC Name: prop-2-enyl N-[[3-(aminomethyl)phenyl]methyl]carbamate; vanadium; hydrate Traditional Name: N-[3-(aminomethyl)benzyl]carbamic acid allyl ester; vanadium; hydrate Formula: C12H18N2O3V MolecularWeight: 289.22442

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NCC1=CC=CC(=C1)CN.O.[V]

Isomeric SMILES

C=CCOC(=O)NCC1=CC=CC(=C1)CN.O.[V]

InChI

InChI=1S/C12H16N2O2.H2O.V/c1-2-6-16-12(15)14-9-11-5-3-4-10(7-11)8-13;;/h2-5,7H,1,6,8-9,13H2,(H,14,15);1H2;