sodium; 4-(aminomethyl)-2-azanyl-1,6-diphenyl-hexan-3-one; aziridine-2-carboxylic acid; methanal

Systemtic Name: sodium; 4-(aminomethyl)-2-azanyl-1,6-diphenyl-hexan-3-one; aziridine-2-carboxylic acid; methanal Openeye Name: sodium; 2-amino-4-(aminomethyl)-1,6-diphenyl-hexan-3-one; aziridine-2-carboxylic acid; formaldehyde CAS Name: sodium; 2-amino-4-(aminomethyl)-1,6-diphenyl-3-hexanone; 2-aziridinecarboxylic acid; formaldehyde IUPAC Name: sodium; 2-amino-4-(aminomethyl)-1,6-diphenylhexan-3-one; aziridine-2-carboxylic acid; formaldehyde Traditional Name: sodium; 2-amino-4-(aminomethyl)-1,6-diphenyl-hexan-3-one; ethylenimine-2-carboxylic acid; formaldehyde Formula: C23H31N3NaO4+ MolecularWeight: 436.49971

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Descriptors Computed from Structure

Canonical SMILES:

C=O.C1C(N1)C(=O)O.C1=CC=C(C=C1)CCC(CN)C(=O)C(CC2=CC=CC=C2)N.[Na+]

Isomeric SMILES

C=O.C1C(N1)C(=O)O.C1=CC=C(C=C1)CCC(CN)C(=O)C(CC2=CC=CC=C2)N.[Na+]

InChI

InChI=1S/C19H24N2O.C3H5NO2.CH2O.Na/c20-14-17(12-11-15-7-3-1-4-8-15)19(22)18(21)13-16-9-5-2-6-10-16;5-3(6)2-1-4-2;1-2;/h1-10,17-18H,11-14,20-21H2;2,4H,1H2,(H,5,6);1H2;/q;;;+1