[[3-(naphthalen-1-ylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] butanoate

Systemtic Name: [[3-(naphthalen-1-ylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] butanoate Openeye Name: [[3-(1-naphthylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] butanoate CAS Name: butanoic acid [[3-(1-naphthalenylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] ester IUPAC Name: [[3-(naphthalen-1-ylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] butanoate Traditional Name: butyric acid [[3-(1-naphthylmethyl)-6,7-dihydro-5H-indazol-4-yl]amino] ester Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)ONC1=C2C(=NN=C2CC3=CC=CC4=CC=CC=C43)CCC1

Isomeric SMILES

CCCC(=O)ONC1=C2C(=NN=C2CC3=CC=CC4=CC=CC=C43)CCC1

InChI

InChI=1S/C22H23N3O2/c1-2-7-21(26)27-25-19-13-6-12-18-22(19)20(24-23-18)14-16-10-5-9-15-8-3-4-11-17(15)16/h3-5,8-11,25H,2,6-7,12-14H2,1H3