3-methoxy-2-[(1-propylindol-3-yl)methyl]-N-sulfonyl-benzamide; methylbenzene

Systemtic Name: 3-methoxy-2-[(1-propylindol-3-yl)methyl]-N-sulfonyl-benzamide; methylbenzene Openeye Name: 3-methoxy-2-[(1-propylindol-3-yl)methyl]-N-sulfonyl-benzamide; toluene CAS Name: 3-methoxy-2-[(1-propyl-3-indolyl)methyl]-N-sulfonylbenzamide; toluene IUPAC Name: 3-methoxy-2-[(1-propylindol-3-yl)methyl]-N-sulfonylbenzamide; toluene Traditional Name: 3-methoxy-2-[(1-propylindol-3-yl)methyl]-N-sulfonyl-benzamide; toluene Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)CC3=C(C=CC=C3OC)C(=O)N=S(=O)=O.CC1=CC=CC=C1

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)CC3=C(C=CC=C3OC)C(=O)N=S(=O)=O.CC1=CC=CC=C1

InChI

InChI=1S/C20H20N2O4S.C7H8/c1-3-11-22-13-14(15-7-4-5-9-18(15)22)12-17-16(20(23)21-27(24)25)8-6-10-19(17)26-2;1-7-5-3-2-4-6-7/h4-10,13H,3,11-12H2,1-2H3;2-6H,1H3