N-[3-(carboxylatoamino)-2-[1-methyl-5-[(triphenylmethyl)amino]pyrazol-4-yl]propyl]carbamate

Systemtic Name: N-[3-(carboxylatoamino)-2-[1-methyl-5-[(triphenylmethyl)amino]pyrazol-4-yl]propyl]carbamate Openeye Name: N-[3-(carboxylatoamino)-2-[1-methyl-5-(tritylamino)pyrazol-4-yl]propyl]carbamate CAS Name: N-[3-(carboxylatoamino)-2-[1-methyl-5-[(triphenylmethyl)amino]-4-pyrazolyl]propyl]carbamate IUPAC Name: N-[3-(carboxylatoamino)-2-[1-methyl-5-(tritylamino)pyrazol-4-yl]propyl]carbamate Traditional Name: N-[3-(carboxylatoamino)-2-[1-methyl-5-(tritylamino)pyrazol-4-yl]propyl]carbamate Formula: C28H27N5O4-2 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(CNC(=O)[O-])CNC(=O)[O-])NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C=N1)C(CNC(=O)[O-])CNC(=O)[O-])NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29N5O4/c1-33-25(24(19-31-33)20(17-29-26(34)35)18-30-27(36)37)32-28(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,19-20,29-30,32H,17-18H2,1H3,(H,34,35)(H,36,37)/p-2