sodium; 1-[2-(aminomethyl)-5-chloranyl-phenyl]-2-azanyl-3-phenyl-propan-1-one; aziridine-2-carboxylic acid; methanal

Systemtic Name: sodium; 1-[2-(aminomethyl)-5-chloranyl-phenyl]-2-azanyl-3-phenyl-propan-1-one; aziridine-2-carboxylic acid; methanal Openeye Name: sodium; 2-amino-1-[2-(aminomethyl)-5-chloro-phenyl]-3-phenyl-propan-1-one; aziridine-2-carboxylic acid; formaldehyde CAS Name: sodium; 2-amino-1-[2-(aminomethyl)-5-chlorophenyl]-3-phenyl-1-propanone; 2-aziridinecarboxylic acid; formaldehyde IUPAC Name: sodium; 2-amino-1-[2-(aminomethyl)-5-chlorophenyl]-3-phenylpropan-1-one; aziridine-2-carboxylic acid; formaldehyde Traditional Name: sodium; 2-amino-1-[2-(aminomethyl)-5-chloro-phenyl]-3-phenyl-propan-1-one; ethylenimine-2-carboxylic acid; formaldehyde Formula: C20H24ClN3NaO4+ MolecularWeight: 428.86503

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Descriptors Computed from Structure

Canonical SMILES:

C=O.C1C(N1)C(=O)O.C1=CC=C(C=C1)CC(C(=O)C2=C(C=CC(=C2)Cl)CN)N.[Na+]

Isomeric SMILES

C=O.C1C(N1)C(=O)O.C1=CC=C(C=C1)CC(C(=O)C2=C(C=CC(=C2)Cl)CN)N.[Na+]

InChI

InChI=1S/C16H17ClN2O.C3H5NO2.CH2O.Na/c17-13-7-6-12(10-18)14(9-13)16(20)15(19)8-11-4-2-1-3-5-11;5-3(6)2-1-4-2;1-2;/h1-7,9,15H,8,10,18-19H2;2,4H,1H2,(H,5,6);1H2;/q;;;+1