sodium; 2-azanyl-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenyl-pentan-3-one; aziridine-2-carboxylic acid; methanal

Systemtic Name: sodium; 2-azanyl-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenyl-pentan-3-one; aziridine-2-carboxylic acid; methanal Openeye Name: sodium; 2-amino-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenyl-pentan-3-one; aziridine-2-carboxylic acid; formaldehyde CAS Name: sodium; 2-amino-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenyl-3-pentanone; 2-aziridinecarboxylic acid; formaldehyde IUPAC Name: sodium; 2-amino-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenylpentan-3-one; aziridine-2-carboxylic acid; formaldehyde Traditional Name: sodium; 2-amino-1-(4-hydroxyphenyl)-5-(methylamino)-4-phenyl-pentan-3-one; ethylenimine-2-carboxylic acid; formaldehyde Formula: C22H29N3NaO5+ MolecularWeight: 438.47253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O2.C3H5NO2.CH2O.Na/c1-20-12-16(14-5-3-2-4-6-14)18(22)17(19)11-13-7-9-15(21)10-8-13;5-3(6)2-1-4-2;1-2;/h2-10,16-17,20-21H,11-12,19H2,1H3;2,4H,1H2,(H,5,6);1H2;/q;;;+1