sodium; aziridine-2-carboxylic acid; 1,4-bis(azanyl)-2,2,5-triphenyl-pentan-3-one; methanal

Systemtic Name: sodium; aziridine-2-carboxylic acid; 1,4-bis(azanyl)-2,2,5-triphenyl-pentan-3-one; methanal Openeye Name: sodium; aziridine-2-carboxylic acid; 1,4-diamino-2,2,5-triphenyl-pentan-3-one; formaldehyde CAS Name: sodium; 2-aziridinecarboxylic acid; 1,4-diamino-2,2,5-triphenyl-3-pentanone; formaldehyde IUPAC Name: sodium; aziridine-2-carboxylic acid; 1,4-diamino-2,2,5-triphenylpentan-3-one; formaldehyde Traditional Name: sodium; 1,4-diamino-2,2,5-triphenyl-pentan-3-one; ethylenimine-2-carboxylic acid; formaldehyde Formula: C27H31N3NaO4+ MolecularWeight: 484.54251

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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)C(CN)(C2=CC=CC=C2)C3=CC=CC=C3)N.[Na+]

Isomeric SMILES

C=O.C1C(N1)C(=O)O.C1=CC=C(C=C1)CC(C(=O)C(CN)(C2=CC=CC=C2)C3=CC=CC=C3)N.[Na+]

InChI

InChI=1S/C23H24N2O.C3H5NO2.CH2O.Na/c24-17-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)22(26)21(25)16-18-10-4-1-5-11-18;5-3(6)2-1-4-2;1-2;/h1-15,21H,16-17,24-25H2;2,4H,1H2,(H,5,6);1H2;/q;;;+1